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4 similar compounds to monomer 50142499

Compile data set for download or QSAR
Wt: 163.2
BDBM50025158
Wt: 149.2
BDBM50142500
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Wt: 164.2
BDBM50291713
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Wt: 320.2
BDBM50127660

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50025158,50142500,50291713,50127660   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50127660
PNG
(CHEMBL3628501)
Show SMILES Clc1ccc(c(Cl)c1)-c1cncc(c1)N1CC2CC(C1)N2
Show InChI InChI=1S/C16H15Cl2N3/c17-11-1-2-15(16(18)4-11)10-3-14(7-19-6-10)21-8-12-5-13(9-21)20-12/h1-4,6-7,12-13,20H,5,8-9H2
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PubMed
1.30E+4n/an/an/an/an/an/an/an/a



University of Sassari

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-Bungarotoxin from alpha7 nAChR in Sprague-Dawley rat hippocampal membranes pre-incubated for 5 mins followed by overnight...


Eur J Med Chem 103: 429-37 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.006
BindingDB Entry DOI: 10.7270/Q2HT2R5N
More data for this
Ligand-Target Pair
S-ribosylhomocysteine lyase


(Bacillus subtilis)
BDBM50142500
PNG
((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...)
Show SMILES CSCC[C@H](N)C(O)=O
Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
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PubMed
6.10E+4n/an/an/an/an/an/an/an/a



The Ohio State University

Curated by ChEMBL


Assay Description
Inhibition of cobalt substituted Bacillus subtilis LuxS


J Med Chem 49: 3003-11 (2006)


Article DOI: 10.1021/jm060047g
BindingDB Entry DOI: 10.7270/Q25X28JQ
More data for this
Ligand-Target Pair
S-adenosylmethionine synthetase (MAT 1 and MAT 2)


(Rattus norvegicus)
BDBM50025158
PNG
(2-Amino-3-methyl-4-methylsulfanyl-butyric acid | C...)
Show SMILES CSCC(C)C(N)C(O)=O
Show InChI InChI=1S/C6H13NO2S/c1-4(3-10-2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)
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5.00E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive inhibitory activity against Methionine adenosyltransferase II


J Med Chem 29: 1743-8 (1986)


Article DOI: 10.1021/jm00159a030
BindingDB Entry DOI: 10.7270/Q24748V9
More data for this
Ligand-Target Pair
S-adenosylmethionine synthetase (MAT 1 and MAT 2)


(Rattus norvegicus)
BDBM50025158
PNG
(2-Amino-3-methyl-4-methylsulfanyl-butyric acid | C...)
Show SMILES CSCC(C)C(N)C(O)=O
Show InChI InChI=1S/C6H13NO2S/c1-4(3-10-2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)
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5.00E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive inhibitory activity against methionine adenosyltransferase


J Med Chem 29: 1743-8 (1986)


Article DOI: 10.1021/jm00159a030
BindingDB Entry DOI: 10.7270/Q24748V9
More data for this
Ligand-Target Pair
Gamma-glutamyltranspeptidase 1


(Rattus norvegicus)
BDBM50142500
PNG
((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...)
Show SMILES CSCC[C@H](N)C(O)=O
Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
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2.69E+7n/an/an/an/an/an/a8.0n/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Compound tested for the inhibition of Gamma-glutamyltranspeptidase in rat kidney at pH 8.0 at 37 degree C (Competitive inhibition)


Bioorg Med Chem Lett 14: 3451-5 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.072
BindingDB Entry DOI: 10.7270/Q2X63NHS
More data for this
Ligand-Target Pair
Fatty acid synthase (FAS)


(Homo sapiens (Human))
BDBM50291713
PNG
(((S)-3-Amino-3-carboxy-propyl)-dimethyl-sulfonium ...)
Show SMILES C[S+](C)CC[C@H](N)C(O)=O
Show InChI InChI=1S/C6H13NO2S/c1-10(2)4-3-5(7)6(8)9/h5H,3-4,7H2,1-2H3/p+1/t5-/m0/s1
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1.40E+8n/an/an/an/an/an/an/an/a



Universit£ Pierre et Marie Curie

Curated by ChEMBL


Assay Description
Inhibition constant against Escherichia coli cyclopropane fatty acid synthase


Bioorg Med Chem Lett 14: 1661-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.01.051
BindingDB Entry DOI: 10.7270/Q26H4HZX
More data for this
Ligand-Target Pair
Fatty acid synthase (FAS)


(Homo sapiens (Human))
BDBM50142500
PNG
((2S)-2-amino-4-(methylsulfanyl)butanoic acid | (S)...)
Show SMILES CSCC[C@H](N)C(O)=O
Show InChI InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1
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>1.50E+8n/an/an/an/an/an/an/an/a



Universit£ Pierre et Marie Curie

Curated by ChEMBL


Assay Description
Inhibition constant against Escherichia coli cyclopropane fatty acid synthase


Bioorg Med Chem Lett 14: 1661-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.01.051
BindingDB Entry DOI: 10.7270/Q26H4HZX
More data for this
Ligand-Target Pair